2-chloranyl-6,7-dimethoxy-4-[(4-methylsulfonylphenyl)methyl]quinazoline

Systemtic Name: 2-chloranyl-6,7-dimethoxy-4-[(4-methylsulfonylphenyl)methyl]quinazoline Openeye Name: 2-chloro-6,7-dimethoxy-4-[(4-methylsulfonylphenyl)methyl]quinazoline CAS Name: 2-chloro-6,7-dimethoxy-4-[(4-methylsulfonylphenyl)methyl]quinazoline IUPAC Name: 2-chloro-6,7-dimethoxy-4-[(4-methylsulfonylphenyl)methyl]quinazoline Traditional Name: 2-chloro-4-(4-mesylbenzyl)-6,7-dimethoxy-quinazoline Formula: C18H17ClN2O4S MolecularWeight: 392.85658

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)Cl)CC3=CC=C(C=C3)S(=O)(=O)C)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)Cl)CC3=CC=C(C=C3)S(=O)(=O)C)OC

InChI

InChI=1S/C18H17ClN2O4S/c1-24-16-9-13-14(20-18(19)21-15(13)10-17(16)25-2)8-11-4-6-12(7-5-11)26(3,22)23/h4-7,9-10H,8H2,1-3H3